Data quality metrics extracted from 9clb.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.2",
  "uuid": "435313f42403c2d1ff40ee099283c6af",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 48.497,
    "b": 74.493,
    "c": 76.315,
    "alpha": 113.13,
    "beta": 90.15,
    "gamma": 105.51
  },
  "wavelengths": [0.95360],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [40.6,2.86],
    "number_observations_unique": 21041,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.20
      },
      {
        "type": "I/SigI",
        "value": 4.7
      },
      {
        "type": "Completeness",
        "value": 96.92
      },
      {
        "type": "Redundancy",
        "value": 3.1
      },
      {
        "type": "CC(1/2)",
        "value": 0.983
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.96,2.86],
      "number_observations_unique": 1921,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.22
        },
        {
          "type": "I/SigI",
          "value": 1.44
        },
        {
          "type": "CC(1/2)",
          "value": 0.49
        }
      ]
    }
  ]

}
  

Table 1 generated from MXLIMS-JSON (via JavaScript):


Binned data generated from MXLIMS-JSON (via JavaScript):